Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Cetrimonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 8/20 | 0.71 |
| ▸ | APAF1 | O14727 | 1/20 | 0.65 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.65 |
| ▸ | RAD52 | P43351 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | APEX1 | P27695 | 3/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ACHE | P22303 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL8438194 | 1.00 | DNM1 (0.71) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Oxalic Acid SCHEMBL8434736 | 1.00 | DNM1 (0.71) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Oxalic Acid SCHEMBL479519 | 1.00 | DNM1 (0.71) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Bicarbonate SCHEMBL9724758 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Bicarbonate SCHEMBL17199724 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Cetrimonium SCHEMBL9739307 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Bicarbonate SCHEMBL5157446 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Bicarbonate SCHEMBL17199718 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Bicarbonate SCHEMBL28963225 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 | |
| Bicarbonate SCHEMBL27839094 | 0.93 | DNM1 (0.75) | DNM1APAF1HSP90AA1RAD52MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101633673-B | Method for preparing oxaliplatin | Nanjing pharmaceutical factory co ltd | 2012-01-11 | — | — | CN | disclosed |
| US-7867471-B2 | Process for preparing advanced ceramic powders using onium dicarboxylates | SACHEM, INC. (US) | 2011-01-11 | — | — | US | disclosed |
| US-20100129728-A1 | ALLOY CATALYST FOR FUEL CELL CATHODE | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2010-05-27 | — | — | US | disclosed |
| CN-101633673-A | Method for preparing oxaliplatin | Nanjing pharmaceutical factory | 2010-01-27 | — | — | CN | disclosed |
| US-20090250850-A1 | PROCESS FOR PREPARING ADVANCED CERAMIC POWDERS USING ONIUM DICARBOXYLATES | SACHEM, INC. | 2009-10-08 | — | — | US | disclosed |
| EP-1947718-A1 | ALLOY CATALYST FOR FUEL CELL CATHODE | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 2008-07-23 | — | — | EP | disclosed |
| US-7341775-B2 | Composition for forming porous film, porous film and method for forming the same, interlevel insulator film, and semiconductor device | MATSUSHITA ELECTRIC INDUSTRIAL CO. LTD. (JP) | 2008-03-11 | — | — | US | disclosed |
| CN-100349981-C | Porous mebrane shaping composition, porous membrane manufacturing method, porous membrane, intercalation insulating film and semiconductor device | SHINETSU CHEMICAL CO (JP) | 2007-11-21 | — | — | CN | disclosed |
| US-20060289849-A1 | Composition for forming porous film, porous film and method for forming the same, interlevel insulator film, and semiconductor device | SHIN-ETSU CHEMICAL CO., LTD. | 2006-12-28 | — | — | US | disclosed |
| US-7119354-B2 | Composition for forming porous film, porous film and method for forming the same, interlevel insulator film | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2006-10-10 | — | — | US | disclosed |
| EP-1580804-A1 | COMPOSITION FOR POROUS FILM FORMATION, POROUS FILMS, PROCESS FOR PRODUCTION OF THE FILMS, INTERLAYER DIELECTRICS, AND SEMICONDUCTOR DEVICES | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 2005-09-28 | — | — | EP | disclosed |
| US-20040235971-A1 | Composition for forming porous film, porous film and method for forming the same, interlevel insulator film, and semiconductor device | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. | 2004-11-25 | — | — | US | disclosed |
| US-20040201007-A1 | Composition for forming porous film, porous film and method for forming the same, interlevel insulator film, and semiconductor device | SHIN-ETSU CHEMICAL CO., LTD. | 2004-10-14 | — | — | US | disclosed |
| CN-1536024-A | Porous mebrane shaping composition, porous membrane manufacturing method, porous membrane, intercalation insulating film and semiconductor device | ��Խ��ѧ��ҵ��ʽ���� | 2004-10-13 | — | — | CN | disclosed |
| US-5933693-A | Electroconductive elastic member and electrophotographic apparatus using same | BRIDGESTONE CORPORATION (JP) | 1999-08-03 | — | — | US | disclosed |